BAS 06402333
TL;DR: BAS 06402333 (CAS 392297-47-1) is a chemical compound with molecular formula C21H23FN4O2S2 and molecular weight 446.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide
Also Known As: BAS 06402333, F0417-0843, (3r,5r,7r)-N-(5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)adamantane-1-carboxamide, N-[5-({[(4-FLUOROPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,3,4-THIADIAZOL-2-YL]ADAMANTANE-1-CARBOXAMIDE, N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide
| Molecular Formula | C21H23FN4O2S2 |
|---|---|
| Molecular Weight | 446.12 g/mol |
| LogP | 4.5629 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.12463 |
| Heavy Atoms | 30 |
| Complexity | 926.88666 |
Chemical Identifiers
| CAS Number | 392297-47-1 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)NC4=NN=C(S4)SCC(=O)NC5=CC=C(C=C5)F |
Product Overview
BAS 06402333 (CAS 392297-47-1), with molecular formula C21H23FN4O2S2 and molecular weight 446.12 g/mol. IUPAC: N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide.
Chemical Property Profile of BAS 06402333
Property Insights of BAS 06402333
The XLogP value of 4.5629 indicates that BAS 06402333 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06402333. Following Lipinski's Rule of Five, BAS 06402333 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 06402333?
The CAS number of BAS 06402333 is 392297-47-1.
What is the molecular formula of BAS 06402333?
The molecular formula of BAS 06402333 is C21H23FN4O2S2.
What is the molecular weight of BAS 06402333?
The molecular weight of BAS 06402333 is 446.12 g/mol.
Where can I buy BAS 06402333?
You can request a quote for BAS 06402333 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06402333?
Yes, KEHONG BIO provides custom synthesis services for BAS 06402333 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.